dimethyl 5-(4-phenylbutanoylamino)benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-(4-phenylbutanoylamino)benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-(4-phenylbutanoylamino)benzene-1,3-dicarboxylate CAS Name: 5-[(1-oxo-4-phenylbutyl)amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-(4-phenylbutanoylamino)benzene-1,3-dicarboxylate Traditional Name: 5-(4-phenylbutanoylamino)benzene-1,3-dicarboxylic acid dimethyl ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CCCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H21NO5/c1-25-19(23)15-11-16(20(24)26-2)13-17(12-15)21-18(22)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,11-13H,6,9-10H2,1-2H3,(H,21,22)